8-[(acridin-9-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(acridin-9-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[(acridin-9-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8012-8660 |
| Compound Name: | 8-[(acridin-9-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C21 H17 N5 O2 S |
| Smiles: | CN1C(c2c(nc(n2C)Sc2c3ccccc3nc3ccccc23)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9846 |
| logD: | 3.9447 |
| logSw: | -4.1193 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.142 |
| InChI Key: | FTNCBSDIFAZMFY-UHFFFAOYSA-N |